Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVILSDLLNRMNKSNRIQTAELDWESIDGIEVPISKQFGDVYFSKDNGLLETRHVFLNGNDLSERLANLQDFEYFSVGETGFGTGLNILALWQLWQQVRPNNHS----HLHAISVEKFPLSKADLIRALNVWDELKPLSKQLIEQYPLPLAGCHRLSFPEERFSIDLWLGDAQDIFPSMVKTK--AVNAWFLDGFAPSCNPDMWEQNVLNNIVRLSDYGTTFASFSVAGVLKRGLKTHGIDISRPRGFGHKREMLKAVWKAPVSEEILLEPVSDTFHFTQQRIAVIGAGIAGLSTAWAFAQRGHQVTLF-ERTAPLSGASGNPLALLNPKPCPIEQSHEHLMTLSWQHALNFYKNFQ---AFRPIQIQQMAL--KNAQDLLDLAD-QYPADIVTQ-------QTSSLESDYPHILLTEAGAVSPHQLRDEIL---QHQGIELKI-ANITTLISFENKVQLKSGNETTLGADHVVVCCARESAALFENYPL-LKPIRGQVSWVDNSFATLPLNEAYSYGGYCIQLNAS--ELILGASFYPSRDDQEVLIDDHVHNFELIHSVFPHYAKQLPP-VEQWQGRASVRAQSPDYFPLVGKMQKESPIST-----------------------FAGLGSKGFLFAPLCSEVLVAQILGEACPVPKSLLQKLDAQRFQKKVKPKKPYFKSQ 3PS9 Chain:A ((1-671)) ---LGTDDDDKMKHYSIQPANLEFNT------PVSRDFDDVYFSNDNGLEETRYVFLGGNQLEVRFPEHPH-PLFVVAESGFGTGLNFLTLWQAFDQFREAHPQAQLQRLHFISFEKFPLTRADLALAHQHWPELAPWAEQLQAQWPMPLPGCHRLLLDAGRVTLDLWFGDINELTSQLDDSLNQKVDAWFLDGFAPAKNPDMWTQNLFNAMARLARPGGTLATFTSAGFVRRGLQDAGFTMQKRKGFGRKREMLCGVMEQTLPLPCS-APWFNRTGSSKREAAIIGGGIASALLSLALLRRGWQVTLYCADEAPALGASGNRQGALYPLLSKHDEALNRFFSNAFTFARRFYDQLPVKFDHDWCGVTQLGWDEKSQHKIAQMLSMDLPAELAVAVEANAVEQITGVATNCSGITYPQGGWLCPAELTRNVLELAQQQGLQIYYQYQLQNFSRKDDCWLLNFAGDQQATHSVVVLANGHQISRFSQTSTLPVYSVAGQVSHIPTTPELAELKQVLCYDGYLTPQNPANQHHCIGASYHRGSEDTAYSEDDQQQNRQRLIDCFPQAQWAKEVDVSDKEARCGVRCATRDHLPMVGNVPDYEATLVEYASLAEQKDEAVSAPVFDDLFMFAALGSRGLCSAPLCAEILAAQMSDEPIPMDASTLAALNPNRLWVRKLLKGK-----

General information: TITO was launched using: RESULT: Template: 3PS9.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 3380 -9194 -2.72 -14.90 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : -2.72 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.410

(partial model without unconserved sides chains): PDB file : Tito_3PS9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3PS9-query.scw PDB file : Tito_Scwrl_3PS9.pdb: